[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 3-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 3-cyanobenzoate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-2-[3-(trifluoromethyl)phenyl]ethyl] ester Formula: C17H10F3NO3 MolecularWeight: 333.26141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)C#N

InChI

InChI=1S/C17H10F3NO3/c18-17(19,20)14-6-2-4-12(8-14)15(22)10-24-16(23)13-5-1-3-11(7-13)9-21/h1-8H,10H2